Base information
| Cat. No. | |
| CAS No. | 17114-40-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H10N2O |
| Molecular Weight | 162.188 |
| Exact Mass | 162.079 |
| XLogP3 | 1.3615 |
| Mr | 48.4267 |
| PSA | 41.99 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1CCC(N1)c1cccnc1 |
